3-(2-methylphenyl)-2-[(2-methylphenyl)methylsulfanyl]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one

Systemtic Name: 3-(2-methylphenyl)-2-[(2-methylphenyl)methylsulfanyl]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 3-(o-tolyl)-2-(o-tolylmethylsulfanyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 3-(2-methylphenyl)-2-[(2-methylphenyl)methylthio]-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 3-(2-methylphenyl)-2-[(2-methylphenyl)methylsulfanyl]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 2-[(2-methylbenzyl)thio]-3-(o-tolyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Formula: C32H32N2OS MolecularWeight: 492.67428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2C4=CC=CC=C4C)C5(CCCCC5)CC6=CC=CC=C63

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2C4=CC=CC=C4C)C5(CCCCC5)CC6=CC=CC=C63

InChI

InChI=1S/C32H32N2OS/c1-22-12-4-6-15-25(22)21-36-31-33-29-26-16-8-7-14-24(26)20-32(18-10-3-11-19-32)28(29)30(35)34(31)27-17-9-5-13-23(27)2/h4-9,12-17H,3,10-11,18-21H2,1-2H3